| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 21 | Yes |
Popular Name: (1S)-2-[(1R,2R,5R)-2-isopropyl-5-methyl-cyclohexoxy]-1-(o-tolyl)ethanamine (1S)-2-[(1R,2R,5R)-2-isopropyl-5…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.47 | 9.27 | -44.01 | 3 | 2 | 1 | 37 | 290.471 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 8.87 | -1.68 | 2 | 2 | 0 | 35 | 289.463 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
